Water → HCID 66813919, compound
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][CH2:8][CH2:9][NH:10][CH2:11][c:12]1[cH:13][cH:14][c:15](-[c:18]2[c:19](-[c:24]3[n:25][n:26][n:27][n:28]3[C:29]([c:30]3[cH:31][cH:32][cH:33][cH:34][cH:35]3)([c:36]3[cH:37][cH:38][cH:39][cH:40][cH:41]3)[c:42]3[cH:43][cH:44][cH:45][cH:46][cH:47]3)[cH:20][cH:21][cH:22][cH:23]2)[cH:16][cH:17]1)=[O:48].[CH:49]([N:50]([CH2:51][CH3:52])[CH:53]([CH3:54])[CH3:55])([CH3:56])[CH3:57].[Cl:58][C:59](=[O:60])[O:61][CH2:62][c:63]1[cH:64][cH:65][cH:66][cH:67][cH:68]1.[Cl:70][CH2:71][Cl:72].[OH2:69]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][CH2:8][CH2:9][N:10]([CH2:11][c:12]1[cH:13][cH:14][c:15](-[c:18]2[c:19](-[c:24]3[n:25][n:26][n:27][n:28]3[C:29]([c:30]3[cH:31][cH:32][cH:33][cH:34][cH:35]3)([c:36]3[cH:37][cH:38][cH:39][cH:40][cH:41]3)[c:42]3[cH:43][cH:44][cH:45][cH:46][cH:47]3)[cH:20][cH:21][cH:22][cH:23]2)[cH:16][cH:17]1)[C:59](=[O:60])[O:61][CH2:62][c:63]1[cH:64][cH:65][cH:66][cH:67][cH:68]1)=[O:48]Participants
6
Sources & evidence
- ORD record
- ord-0ed4569023844db19c06ef1e19e2075d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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